CID 44780

N-(6-(dimethylamino)-4,4-diphenyl-3-heptylidene)acetamide hydrochloride

Structural Information

Molecular Formula
C23H30N2O
SMILES
CCC(=NC(=O)C)C(CC(C)N(C)C)(C1=CC=CC=C1)C2=CC=CC=C2
InChI
InChI=1S/C23H30N2O/c1-6-22(24-19(3)26)23(17-18(2)25(4)5,20-13-9-7-10-14-20)21-15-11-8-12-16-21/h7-16,18H,6,17H2,1-5H3
InChIKey
NJFKSPAGUGTCMW-UHFFFAOYSA-N
Compound name
N-[6-(dimethylamino)-4,4-diphenylheptan-3-ylidene]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

350.2358 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 351.24308 189.7
[M+Na]+ 373.22502 191.5
[M-H]- 349.22852 197.6
[M+NH4]+ 368.26962 202.7
[M+K]+ 389.19896 189.2
[M+H-H2O]+ 333.23306 180.4
[M+HCOO]- 395.23400 211.1
[M+CH3COO]- 409.24965 226.6
[M+Na-2H]- 371.21047 190.7
[M]+ 350.23525 191.2
[M]- 350.23635 191.2
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.