CID 75100

Bis(2,6-diisopropylphenyl)carbodiimide

Structural Information

Molecular Formula
C25H34N2
SMILES
CC(C)C1=C(C(=CC=C1)C(C)C)N=C=NC2=C(C=CC=C2C(C)C)C(C)C
InChI
InChI=1S/C25H34N2/c1-16(2)20-11-9-12-21(17(3)4)24(20)26-15-27-25-22(18(5)6)13-10-14-23(25)19(7)8/h9-14,16-19H,1-8H3
InChIKey
XLDBGFGREOMWSL-UHFFFAOYSA-N
Compound name
N,N'-bis[2,6-di(propan-2-yl)phenyl]methanediimine
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

3
References

3175
Patents

362.2722 Da
Monoisotopic Mass

9.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 363.279476 194.9
[M+Na]+ 385.261418 199.2
[M-H]- 361.264924 203.7
[M+NH4]+ 380.306023 208.7
[M+K]+ 401.235358 195.5
[M+H-H2O]+ 345.269460 185.7
[M+HCOO]- 407.270401 216.9
[M+CH3COO]- 421.286051 235.0
[M+Na-2H]- 383.246866 191.1
[M]+ 362.27165142 197.8
[M]- 362.27274858 197.8
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