CID 205908

Brn 2742037

Structural Information

Molecular Formula
C16H27NO3
SMILES
CC1C2CCC(C2)C1CN(CCO)C(=O)CCC(=O)C
InChI
InChI=1S/C16H27NO3/c1-11(19)3-6-16(20)17(7-8-18)10-15-12(2)13-4-5-14(15)9-13/h12-15,18H,3-10H2,1-2H3
InChIKey
GQNWRHOYVLTGFV-UHFFFAOYSA-N
Compound name
N-(2-hydroxyethyl)-N-[(3-methyl-2-bicyclo[2.2.1]heptanyl)methyl]-4-oxopentanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

281.1991 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 282.20638 173.6
[M+Na]+ 304.18832 176.8
[M-H]- 280.19182 175.3
[M+NH4]+ 299.23292 194.1
[M+K]+ 320.16226 175.1
[M+H-H2O]+ 264.19636 168.5
[M+HCOO]- 326.19730 191.2
[M+CH3COO]- 340.21295 205.9
[M+Na-2H]- 302.17377 170.1
[M]+ 281.19855 174.6
[M]- 281.19965 174.6
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.