CID 14872606

N-(cyclohexylmethyl)prop-2-enamide

Structural Information

Molecular Formula
C10H17NO
SMILES
C=CC(=O)NCC1CCCCC1
InChI
InChI=1S/C10H17NO/c1-2-10(12)11-8-9-6-4-3-5-7-9/h2,9H,1,3-8H2,(H,11,12)
InChIKey
XJKTZVTYQXQHHB-UHFFFAOYSA-N
Compound name
N-(cyclohexylmethyl)prop-2-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

513
Patents

167.13101 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 168.13829 139.3
[M+Na]+ 190.12023 142.7
[M-H]- 166.12373 141.6
[M+NH4]+ 185.16483 159.1
[M+K]+ 206.09417 140.9
[M+H-H2O]+ 150.12827 133.3
[M+HCOO]- 212.12921 159.8
[M+CH3COO]- 226.14486 180.7
[M+Na-2H]- 188.10568 143.0
[M]+ 167.13046 133.8
[M]- 167.13156 133.8
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

patents stripe