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]+ 168.138286 141.5
[M+Na]+ 190.120228 148.6
[M-H]- 166.123734 146.8
[M+NH4]+ 185.164833 155.7
[M+K]+ 206.094168 146.0
[M+H-H2O]+ 150.128270 134.0
[M+HCOO]- 212.129211 161.0
[M+CH3COO]- 226.144861 182.3
[M+Na-2H]- 188.105676 145.7
[M]+ 167.13046142 140.2
[M]- 167.13155858 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