CID 18002181

1-(cyclopropylmethyl)piperidin-4-one

Structural Information

Molecular Formula
C9H15NO
SMILES
C1CC1CN2CCC(=O)CC2
InChI
InChI=1S/C9H15NO/c11-9-3-5-10(6-4-9)7-8-1-2-8/h8H,1-7H2
InChIKey
WEGGUCATBXAQDP-UHFFFAOYSA-N
Compound name
1-(cyclopropylmethyl)piperidin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

59
Patents

153.11537 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 154.12265 137.3
[M+Na]+ 176.10459 144.8
[M-H]- 152.10809 142.8
[M+NH4]+ 171.14919 152.1
[M+K]+ 192.07853 142.5
[M+H-H2O]+ 136.11263 130.0
[M+HCOO]- 198.11357 157.1
[M+CH3COO]- 212.12922 179.4
[M+Na-2H]- 174.09004 142.0
[M]+ 153.11482 135.7
[M]- 153.11592 135.7
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