CID 24836130

D-3-((diethylamino)methyl)camphor o-(p-methoxycarbaniloyl)oxime hydrochloride

Structural Information

Molecular Formula
C23H35N3O3
SMILES
CCN(CC)CC\1[C@H]2CC[C@@](/C1=N\OC(=O)NC3=CC=C(C=C3)OC)(C2(C)C)C
InChI
InChI=1S/C23H35N3O3/c1-7-26(8-2)15-18-19-13-14-23(5,22(19,3)4)20(18)25-29-21(27)24-16-9-11-17(28-6)12-10-16/h9-12,18-19H,7-8,13-15H2,1-6H3,(H,24,27)/b25-20-/t18?,19-,23+/m1/s1
InChIKey
QAAHZKCWBRUBNL-SVGUFZLRSA-N
Compound name
[(Z)-[(1R,4R)-3-(diethylaminomethyl)-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanylidene]amino] N-(4-methoxyphenyl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

401.26785 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 402.27513 196.6
[M+Na]+ 424.25707 201.2
[M-H]- 400.26057 204.8
[M+NH4]+ 419.30167 217.4
[M+K]+ 440.23101 199.2
[M+H-H2O]+ 384.26511 190.6
[M+HCOO]- 446.26605 219.5
[M+CH3COO]- 460.28170 236.5
[M+Na-2H]- 422.24252 196.9
[M]+ 401.26730 202.0
[M]- 401.26840 202.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.