CID 22149714

1-methyl-2-phenylpiperazine

Structural Information

Molecular Formula
C11H16N2
SMILES
CN1CCNCC1C2=CC=CC=C2
InChI
InChI=1S/C11H16N2/c1-13-8-7-12-9-11(13)10-5-3-2-4-6-10/h2-6,11-12H,7-9H2,1H3
InChIKey
FUGQHVIDCRUGMP-UHFFFAOYSA-N
Compound name
1-methyl-2-phenylpiperazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

170
Patents

176.13135 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 177.13863 141.2
[M+Na]+ 199.12057 154.5
[M+NH4]+ 194.16517 150.2
[M+K]+ 215.09451 146.9
[M-H]- 175.12407 144.7
[M+Na-2H]- 197.10602 149.3
[M]+ 176.13080 144.1
[M]- 176.13190 144.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe