CID 106590

1-cyclohexyl-2,5-dihydro-1h-pyrrole

Structural Information

Molecular Formula
C10H17N
SMILES
C1CCC(CC1)N2CC=CC2
InChI
InChI=1S/C10H17N/c1-2-6-10(7-3-1)11-8-4-5-9-11/h4-5,10H,1-3,6-9H2
InChIKey
MKLOLLWXCNJJKG-UHFFFAOYSA-N
Compound name
1-cyclohexyl-2,5-dihydropyrrole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

151.1361 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 152.143376 135.0
[M+Na]+ 174.125318 139.0
[M-H]- 150.128824 139.0
[M+NH4]+ 169.169923 155.9
[M+K]+ 190.099258 137.2
[M+H-H2O]+ 134.133360 127.6
[M+HCOO]- 196.134301 154.4
[M+CH3COO]- 210.149951 147.1
[M+Na-2H]- 172.110766 138.4
[M]+ 151.13555142 128.1
[M]- 151.13664858 128.1
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