CID 9568624

101418-03-5

Structural Information

Molecular Formula
C14H27N3O2
SMILES
CC1CCC(C(C1)OC(=O)N/N=C/N(C)C)C(C)C
InChI
InChI=1S/C14H27N3O2/c1-10(2)12-7-6-11(3)8-13(12)19-14(18)16-15-9-17(4)5/h9-13H,6-8H2,1-5H3,(H,16,18)/b15-9+
InChIKey
HQSDMDPBSJPNOS-OQLLNIDSSA-N
Compound name
(5-methyl-2-propan-2-ylcyclohexyl) N-[(E)-dimethylaminomethylideneamino]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

269.21033 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 270.217606 167.5
[M+Na]+ 292.199548 169.7
[M-H]- 268.203054 172.6
[M+NH4]+ 287.244153 184.4
[M+K]+ 308.173488 170.5
[M+H-H2O]+ 252.207590 159.8
[M+HCOO]- 314.208531 189.8
[M+CH3COO]- 328.224181 213.0
[M+Na-2H]- 290.184996 166.8
[M]+ 269.20978142 166.5
[M]- 269.21087858 166.5
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.