CID 62656102

1-(cyclopropylmethyl)piperidine-4-carbaldehyde

Structural Information

Molecular Formula
C10H17NO
SMILES
C1CC1CN2CCC(CC2)C=O
InChI
InChI=1S/C10H17NO/c12-8-10-3-5-11(6-4-10)7-9-1-2-9/h8-10H,1-7H2
InChIKey
OPTAOGCMXISGFK-UHFFFAOYSA-N
Compound name
1-(cyclopropylmethyl)piperidine-4-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

167.13101 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 168.13829 141.5
[M+Na]+ 190.12023 148.6
[M-H]- 166.12373 146.8
[M+NH4]+ 185.16483 155.7
[M+K]+ 206.09417 146.0
[M+H-H2O]+ 150.12827 134.0
[M+HCOO]- 212.12921 161.0
[M+CH3COO]- 226.14486 182.3
[M+Na-2H]- 188.10568 145.7
[M]+ 167.13046 140.2
[M]- 167.13156 140.2
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

patents stripe